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N-甲基苯甲酰胺

N-甲基苯甲酰胺用途

N-Methylbenzamide 是一种有效的磷酸二酯酶 10A (PDE10A) 抑制剂。N-Methylbenzamide 具有抗癌活性。

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N-甲基苯甲酰胺名称

[ CAS 号 ]:
613-93-4

[ 中文名 ]:
N-甲基苯甲酰胺

[ 英文名 ]:
1MVR

[中文别名 ]:

N-甲基苯甲醯胺

[英文别名 ]:

N-MethylbenzaMide 10GR
n-methylbenzenecarboxamide
N-Methylbenzamide
N-Methylbenzenamide
n-methyl-benzamid
N-methyl benzamide
EINECS 210-362-3
Benzamide,N-methyl-(6CI,7CI,8CI,9CI)
MFCD00011642
Benzamide, N-methyl-

N-甲基苯甲酰胺生物活性

[ 描述 ]:

N-Methylbenzamide 是一种有效的磷酸二酯酶 10A (PDE10A) 抑制剂。N-Methylbenzamide 具有抗癌活性。

[ 相关类别 ]:

研究领域 >> 癌症

信号通路 >> 代谢酶/蛋白酶 >> 磷酸二酯酶(PDE)

[ 靶点 ]

PDE10A

[体内研究]

N-甲基苯甲酰胺(化合物21；100-800 mg/kg；ip；17天)对供体雌性BDF小鼠(18-23 g)的肿瘤具有活性[2]。

[参考文献]

[1]. Kilburn JP, et al. N-Methylanilide and N-methylbenzamide derivatives as phosphodiesterase 10A (PDE10A) inhibitors. Bioorg Med Chem. 2013 Oct 1;21(19):6053-62.

[2]. Gate, E. N., et al. Structural studies on bioactive compounds. 4. A structure-antitumor activity study on analogs of N-methylformamide. Journal of Medicinal Chemistry, 1986, 29(6), 1046–1052.

N-甲基苯甲酰胺物理化学性质

[ 密度 ]:
1.0±0.1 g/cm3

[ 沸点 ]:
254.9±23.0 °C at 760 mmHg

[ 熔点 ]:
76-78 °C(lit.)

[ 分子式 ]:
C₈H₉NO

[ 分子量 ]:
135.163

[ 闪点 ]:
145.6±11.9 °C

[ 精确质量 ]:
135.068420

[ PSA ]:
29.10000

[ LogP ]:
1.66

[ 外观性状 ]:
白色晶体或结晶粉末

[ 蒸汽压 ]:
0.0±0.5 mmHg at 25°C

[ 折射率 ]:
1.519

[ 储存条件 ]:
存放于惰性气体之中;避免空气

N-甲基苯甲酰胺MSDS

详细MSDS(安全技术说明书)

N-甲基苯甲酰胺毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CV5570000

CHEMICAL NAME :: Benzamide, N-methyl-

CAS REGISTRY NUMBER :: 613-93-4

BEILSTEIN REFERENCE NO. :: 1209880

LAST UPDATED :: 199709

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C8-H9-N-O

MOLECULAR WEIGHT :: 135.18

WISWESSER LINE NOTATION :: 1MVR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 840 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 19,20,1971

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N-甲基苯甲酰胺安全信息

[ 符号 ]:

GHS07

[ 信号词 ]:
Warning

[ 危害声明 ]:
H302

[ 危害码 (欧洲) ]:
Xn

[ 风险声明 (欧洲) ]:
R20/21/22

[ 安全声明 (欧洲) ]:
S24/25

[ 危险品运输编码 ]:
NONH for all modes of transport

[ WGK德国 ]:
1

[ RTECS号 ]:
CV5570000

N-甲基苯甲酰胺文献

Thermodynamic analysis of the binding of aromatic hydroxamic acid analogues to ferric horseradish peroxidase.

Biochemistry 40(46) , 13980-9, (2001)

Peroxidases typically bind their reducing substrates weakly, with K(d) values in the millimolar range. The binding of benzhydroxamic acid (BHA) to ferric horseradish peroxidase isoenzyme C (HRPC) [K(d...

N-Methylanilide and N-methylbenzamide derivatives as phosphodiesterase 10A (PDE10A) inhibitors.

Bioorg. Med. Chem. 21(19) , 6053-62, (2013)

PDE10A is a recently identified phosphodiesterase with a quite remarkable localization since the protein is abundant only in brain tissue. Based on this unique localization, research has focused exten...

Molecular electrostatic potential of orthopramides: implications for their interaction with the D-2 dopamine receptor.

J. Med. Chem. 29(5) , 600-6, (1986)

The electronic properties of orthopramides, a group of selective D-2 dopamine receptor antagonists, were investigated by calculating molecular electrostatic potentials (MEP) of model compounds with th...

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